SCHEMBL1179532

SCHEMBL1179532

Cc1ccc(CBr)cc1C(=O)O

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 1/20 0.49
CYP4A11 Q02928 1/20 0.49
HMGB1 P09429 1/20 0.46
CXCL12 P48061 1/20 0.46
CFD P00746 1/20 0.45
KLKB1 P03952 1/20 0.44
CTSB P07858 1/20 0.44
MMP9 P14780 1/20 0.44
DNMT1 P26358 1/20 0.44
DNMT3B Q9UBC3 1/20 0.44
DNMT3L Q9UJW3 1/20 0.44
DNMT3A Q9Y6K1 1/20 0.44
ALDH1A1 P00352 2/20 0.43
CDC25B P30305 1/20 0.43
CASP6 P55212 1/20 0.43
RCE1 Q9Y256 1/20 0.43
LCK P06239 1/20 0.41
CES2 O00748 1/20 0.40
CES1 P23141 1/20 0.40
MCL1 Q07820 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL33493 0.85 NR1H4 (0.50) CYP4F2CYP4A11HMGB1CXCL12CFD
SCHEMBL6859574 0.84 KLKB1 (0.62) HMGB1CXCL12CFDKLKB1CTSB
SCHEMBL11133853 0.83 CYP4F2 (0.51) CYP4F2CYP4A11HMGB1CXCL12CFD
SCHEMBL5225010 0.82 HMGB1 (0.47) HMGB1CXCL12CFDKLKB1CTSB
SCHEMBL13652492 0.82 ALDH1A1 (0.50) HMGB1CXCL12CFDKLKB1CTSB
SCHEMBL2857663 0.82 KLKB1 (0.48) CYP4F2CYP4A11CFDKLKB1CTSB
SCHEMBL15177931 0.81 KDM4E (0.50) HMGB1CXCL12KLKB1CTSBMMP9
SCHEMBL11445335 0.81 HMGB1 (0.46) HMGB1CXCL12CFDKLKB1CTSB
SCHEMBL19748200 0.81 HMGB1 (0.46) HMGB1CXCL12CFDKLKB1CTSB
SCHEMBL1671899 0.81 ALDH1A1 (0.47) HMGB1CXCL12CFDKLKB1CTSB

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250025443-A1 COMPOUNDS AND METHODS FOR TREATING CORONA VIRUSES Clear Creek Bio, Inc. (US) 2025-01-23 US disclosed
CN-117700323-A WO loaded by molecular sieve 3 Catalytic preparation method of bromine-substituted benzoate 大连金点生物科技有限公司 2024-03-15 CN disclosed
CN-117700323-A WO loaded by molecular sieve 3 Catalytic preparation method of bromine-substituted benzoate 大连金点生物科技有限公司 2024-03-15 CN disclosed
CN-117242073-A PRMT5 inhibitors and uses thereof 海思科医药集团股份有限公司 2023-12-15 CN disclosed
WO-2023064493-A1 COMPOUNDS AND METHODS FOR TREATING CORONAVIRUSES Clear Creek Bio, Inc. (US) 2023-04-20 WO disclosed
CN-104220422-B EP1 receptors ligands 埃斯特韦实验室有限公司 2017-11-07 CN disclosed
US-20110034507-A1 FARNESOID X RECEPTOR AGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2011-02-10 US disclosed
US-20110034507-A1 FARNESOID X RECEPTOR AGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2011-02-10 US disclosed
US-20110034507-A1 FARNESOID X RECEPTOR AGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2011-02-10 US disclosed
CN-101877966-A Farnesoid X receptor agonists SMITHKLINE BEECHAM CORP 2010-11-03 CN disclosed
EP-2173174-A1 FARNESOID X RECEPTOR AGONISTS GlaxoSmithKline LLC (US) 2010-04-14 EP disclosed
WO-2009005998-A1 FARNESOID X RECEPTOR AGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2009-01-08 WO disclosed
WO-2009005998-A1 FARNESOID X RECEPTOR AGONISTS SMITHKLINE BEECHAM CORPORATION (US) 2009-01-08 WO disclosed
EP-0777492-B1 COMBINATORIAL LIBRARIES OF SUBSTRATE-BOUND CYCLIC ORGANIC COMPOUNDS CHIRON CORP (US) 2005-01-19 EP disclosed
EP-0777492-A4 COMBINATORIAL LIBRARIES OF SUBSTRATE-BOUND CYCLIC ORGANIC COMPOUNDS CHIRON CORP (US) 2002-11-27 EP disclosed
US-5958792-A DERIVATIZING SOLID SUPPORT SURFACES WITH A GROUP CONSISTING OF O AND NH TO PROVIDE PLURALITY OF DERIVATIZED SUPPORT SURFACES, DIVIDING THEM INTO SUBAMOUNTS, REACTING DIFFERENT SUBMONOMER WITH ACTIVE GROUP OF SUBAMOUNT, RECOMBINING CHIRON CORPORATION (US) 1999-09-28 US disclosed
EP-0777492-A1 COMBINATORIAL LIBRARIES OF SUBSTRATE-BOUND CYCLIC ORGANIC COMPOUNDS CHIRON CORPORATION (US) 1997-06-11 EP disclosed
WO-1996040201-A1 COMBINATORIAL LIBRARIES OF SUBSTRATE-BOUND CYCLIC ORGANIC COMPOUNDS CHIRON CORPORATION (US) 1996-12-19 WO disclosed
US-4448987-A Catalyzed hydrogenation of terephthalic acid to p-hydroxymethylbenzoic acid using a rhenium catalyst STANDARD OIL COMPANY (INDIANA) (US) 1984-05-15 US disclosed
US-4130719-A POLY(METHYLENEBENZOATES STANDARD OIL COMPANY (INDIANA) (US) 1978-12-19 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20110034507-A1 FARNESOID X RECEPTOR AGONISTS NR1H4, NR1H3, NR1H2 CYP4F2 105/4885CYP4A11 35/4885HMGB1 2630/4885
US-20250025443-A1 COMPOUNDS AND METHODS FOR TREATING CORONA VIRUSES ACE, PREP, PEPD CYP4F2 3453/4885CYP4A11 1298/4885HMGB1 3254/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.